3-dodecyl-1-[(4-fluorophenyl)methyl]-1-(3-morpholin-4-ylpropyl)thiourea

Systemtic Name: 3-dodecyl-1-[(4-fluorophenyl)methyl]-1-(3-morpholin-4-ylpropyl)thiourea Openeye Name: 3-dodecyl-1-[(4-fluorophenyl)methyl]-1-(3-morpholinopropyl)thiourea CAS Name: 3-dodecyl-1-[(4-fluorophenyl)methyl]-1-[3-(4-morpholinyl)propyl]thiourea IUPAC Name: 3-dodecyl-1-[(4-fluorophenyl)methyl]-1-(3-morpholin-4-ylpropyl)thiourea Traditional Name: 1-(4-fluorobenzyl)-3-lauryl-1-(3-morpholinopropyl)thiourea Formula: C27H46FN3OS MolecularWeight: 479.737043

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNC(=S)N(CCCN1CCOCC1)CC2=CC=C(C=C2)F

Isomeric SMILES

CCCCCCCCCCCCNC(=S)N(CCCN1CCOCC1)CC2=CC=C(C=C2)F

InChI

InChI=1S/C27H46FN3OS/c1-2-3-4-5-6-7-8-9-10-11-17-29-27(33)31(24-25-13-15-26(28)16-14-25)19-12-18-30-20-22-32-23-21-30/h13-16H,2-12,17-24H2,1H3,(H,29,33)